SCHEMBL8425634

SCHEMBL8425634

CCCCCCCCOc1ccc(Br)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.51
THRA P10827 2/20 0.50
THRB P10828 2/20 0.50
TSHR P16473 2/20 0.50
PDIA6 Q15084 1/20 0.49
TP53 P04637 1/20 0.46
LTA4H P09960 2/20 0.46
SMPD1 P17405 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PLA2G4B P0C869 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6503962 0.95 SMN1; SMN2 (0.49) NR5A1THRATHRBTSHRPDIA6
SCHEMBL25407032 0.93 PDIA6 (0.54) THRATHRBTSHRPDIA6TP53
SCHEMBL25406440 0.93 PDIA6 (0.54) THRATHRBTSHRPDIA6TP53
SCHEMBL9931333 0.87 SMN1; SMN2 (0.49) TSHRPDIA6LTA4HSMN1; SMN2
SCHEMBL25405576 0.87 PDIA6 (0.51) TSHRPDIA6SMN1; SMN2
SCHEMBL27847653 0.86 THRA (0.55) NR5A1THRATHRBTSHRTP53
SCHEMBL862420 0.84 NR5A1 (0.53) NR5A1THRATHRBTSHRTP53
SCHEMBL11369041 0.84 NR5A1 (0.56) NR5A1THRATHRBTSHRPDIA6
SCHEMBL9252588 0.84 NR5A1 (0.56) NR5A1THRATHRBTSHRPDIA6
SCHEMBL11375096 0.84 NR5A1 (0.56) NR5A1THRATHRBTSHRPDIA6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11180904-A None JP disclosed
JP-H11180904-A DISCOTIC LIQUID CRYSTALLINE COMPOUND FUJI PHOTO FILM CO LTD 1999-07-06 JP disclosed